hexyl 3-hexyl-2,4-bis(oxidanylidene)-5-[2-[(9-oxidanylidene-10H-acridin-3-yl)amino]ethanoylamino]-1H-pyrimidine-6-carboxylate

Systemtic Name: hexyl 3-hexyl-2,4-bis(oxidanylidene)-5-[2-[(9-oxidanylidene-10H-acridin-3-yl)amino]ethanoylamino]-1H-pyrimidine-6-carboxylate Openeye Name: hexyl 3-hexyl-2,4-dioxo-5-[[2-[(9-oxo-10H-acridin-3-yl)amino]acetyl]amino]-1H-pyrimidine-6-carboxylate CAS Name: 3-hexyl-2,4-dioxo-5-[[1-oxo-2-[(9-oxo-10H-acridin-3-yl)amino]ethyl]amino]-1H-pyrimidine-6-carboxylic acid hexyl ester IUPAC Name: hexyl 3-hexyl-2,4-dioxo-5-[[2-[(9-oxo-10H-acridin-3-yl)amino]acetyl]amino]-1H-pyrimidine-6-carboxylate Traditional Name: 3-hexyl-2,4-diketo-5-[[2-[(9-keto-10H-acridin-3-yl)amino]acetyl]amino]-1H-pyrimidine-6-carboxylic acid hexyl ester Formula: C32H39N5O6 MolecularWeight: 589.68196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(=C(NC1=O)C(=O)OCCCCCC)NC(=O)CNC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCCCCCN1C(=O)C(=C(NC1=O)C(=O)OCCCCCC)NC(=O)CNC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C32H39N5O6/c1-3-5-7-11-17-37-30(40)27(28(36-32(37)42)31(41)43-18-12-8-6-4-2)35-26(38)20-33-21-15-16-23-25(19-21)34-24-14-10-9-13-22(24)29(23)39/h9-10,13-16,19,33H,3-8,11-12,17-18,20H2,1-2H3,(H,34,39)(H,35,38)(H,36,42)